N-tert-butyl-2-[(4-chlorophenyl)carbonyl-(3-methylphenyl)amino]-3-methyl-4H-quinazoline-4-carboxamide

Systemtic Name: N-tert-butyl-2-[(4-chlorophenyl)carbonyl-(3-methylphenyl)amino]-3-methyl-4H-quinazoline-4-carboxamide Openeye Name: N-tert-butyl-2-(N-(4-chlorobenzoyl)-3-methyl-anilino)-3-methyl-4H-quinazoline-4-carboxamide CAS Name: N-tert-butyl-2-(N-[(4-chlorophenyl)-oxomethyl]-3-methylanilino)-3-methyl-4H-quinazoline-4-carboxamide IUPAC Name: N-tert-butyl-2-(N-(4-chlorobenzoyl)-3-methylanilino)-3-methyl-4H-quinazoline-4-carboxamide Traditional Name: N-tert-butyl-2-(N-(4-chlorobenzoyl)-3-methyl-anilino)-3-methyl-4H-quinazoline-4-carboxamide Formula: C28H29ClN4O2 MolecularWeight: 489.00846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(C2=NC3=CC=CC=C3C(N2C)C(=O)NC(C)(C)C)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC(=CC=C1)N(C2=NC3=CC=CC=C3C(N2C)C(=O)NC(C)(C)C)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C28H29ClN4O2/c1-18-9-8-10-21(17-18)33(26(35)19-13-15-20(29)16-14-19)27-30-23-12-7-6-11-22(23)24(32(27)5)25(34)31-28(2,3)4/h6-17,24H,1-5H3,(H,31,34)